3-[[3,4-bis(fluoranyl)phenyl]sulfonylamino]-N-(1-propan-2-ylpiperidin-1-ium-4-yl)propanamide

Systemtic Name: 3-[[3,4-bis(fluoranyl)phenyl]sulfonylamino]-N-(1-propan-2-ylpiperidin-1-ium-4-yl)propanamide Openeye Name: 3-[(3,4-difluorophenyl)sulfonylamino]-N-(1-isopropylpiperidin-1-ium-4-yl)propanamide CAS Name: 3-[(3,4-difluorophenyl)sulfonylamino]-N-(1-propan-2-yl-4-piperidin-1-iumyl)propanamide IUPAC Name: 3-[(3,4-difluorophenyl)sulfonylamino]-N-(1-propan-2-ylpiperidin-1-ium-4-yl)propanamide Traditional Name: 3-[(3,4-difluorophenyl)sulfonylamino]-N-(1-isopropylpiperidin-1-ium-4-yl)propionamide Formula: C17H26F2N3O3S+ MolecularWeight: 390.468446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)NC(=O)CCNS(=O)(=O)C2=CC(=C(C=C2)F)F

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)NC(=O)CCNS(=O)(=O)C2=CC(=C(C=C2)F)F

InChI

InChI=1S/C17H25F2N3O3S/c1-12(2)22-9-6-13(7-10-22)21-17(23)5-8-20-26(24,25)14-3-4-15(18)16(19)11-14/h3-4,11-13,20H,5-10H2,1-2H3,(H,21,23)/p+1